phenyl N-[1-[2-[(4-cyanophenyl)amino]propanoylamino]-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: phenyl N-[1-[2-[(4-cyanophenyl)amino]propanoylamino]-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: phenyl N-[1-[2-(4-cyanoanilino)propanoylcarbamoyl]propyl]carbamate CAS Name: N-[1-[[2-(4-cyanoanilino)-1-oxopropyl]amino]-1-oxobutan-2-yl]carbamic acid phenyl ester IUPAC Name: phenyl N-[1-[2-(4-cyanoanilino)propanoylamino]-1-oxobutan-2-yl]carbamate Traditional Name: N-[1-[2-(4-cyanoanilino)propanoylcarbamoyl]propyl]carbamic acid phenyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(=O)C(C)NC1=CC=C(C=C1)C#N)NC(=O)OC2=CC=CC=C2

Isomeric SMILES

CCC(C(=O)NC(=O)C(C)NC1=CC=C(C=C1)C#N)NC(=O)OC2=CC=CC=C2

InChI

InChI=1S/C21H22N4O4/c1-3-18(24-21(28)29-17-7-5-4-6-8-17)20(27)25-19(26)14(2)23-16-11-9-15(13-22)10-12-16/h4-12,14,18,23H,3H2,1-2H3,(H,24,28)(H,25,26,27)